Ethanol → HCID 178475858, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][CH:6]1[CH:7]([CH2:36][NH:37][CH2:38][c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[CH:8]([c:29]2[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]2)[CH:9]([O:12][CH:13]([CH3:14])[c:15]2[cH:16][c:17]([C:25]([F:26])([F:27])[F:28])[cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]2)[CH2:10][CH2:11]1.[CH3:45][CH2:46][OH:47]>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][CH:6]1[CH:7]([CH2:36][NH2:37])[CH:8]([c:29]2[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]2)[CH:9]([O:12][CH:13]([CH3:14])[c:15]2[cH:16][c:17]([C:25]([F:26])([F:27])[F:28])[cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]2)[CH2:10][CH2:11]1Participants
3
Sources & evidence
- ORD record
- ord-d5b92ac2d95a4f738894d42bbd887931
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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